⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2035324 | 1.00 | — | — | |
| SCHEMBL640168 | 1.00 | — | — | |
| SCHEMBL10912208 | 0.97 | TP53 (0.42) | — | |
| SCHEMBL9630250 | 0.89 | ALDH1A1 (0.37) | — | |
| Carbonotrithioic Acid SCHEMBL28986971 | 0.87 | ALDH1A1 (0.36) | — | |
| Malic Acid SCHEMBL6120864 | 0.81 | SMN1; SMN2 (0.65) | — | |
| SCHEMBL10380813 | 0.79 | GPR84 (0.50) | — | |
| SCHEMBL42068 | 0.78 | — | — | |
| SCHEMBL106774 | 0.78 | — | — | |
| SCHEMBL12927538 | 0.78 | CPT2 (0.42) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1040 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116818930-A | Chiral detection method of (S) - (-) -2-hydroxy-3, 3-dimethylbutyric acid | 上海吉奉生物科技有限公司 | 2023-09-29 | — | — | CN | claimed |
| CN-114634955-B | Method for preparing L-tertiary leucine by biological enzyme catalysis and application thereof | 金达威生物技术(江苏)有限公司 | 2023-07-18 | — | — | CN | claimed |
| CN-111205397-B | Ionic liquid grafted cellulose nanocrystal and preparation method thereof | 青岛科技大学 | 2022-08-23 | — | — | CN | claimed |
| CN-114634955-A | Method for preparing L-tert-leucine through biological enzyme catalysis and application thereof | 金达威生物技术(江苏)有限公司 | 2022-06-17 | — | — | CN | claimed |
| CN-109563106-B | Silver ion carboxylate alkyl primary amine complexes | 柯达公司 | 2021-07-27 | — | — | CN | claimed |
| CN-109562628-B | Silver ion carboxylate N-heteroaromatic complex and use | 柯达公司 | 2021-07-27 | — | — | CN | claimed |
| EP-3496951-B1 | SILVER ION CARBOXYLATE N-HETEROAROMATIC COMPLEXES AND USES | EASTMAN KODAK CO (US) | 2021-06-23 | — | — | EP | claimed |
| CN-113004141-A | Process for the preparation of 3, 3-dimethyl-2-oxobutanoic acid and triazinones | 北京颖泰嘉和生物科技股份有限公司 | 2021-06-22 | — | — | CN | claimed |
| US-11037692-B2 | Articles having silver ion α-oxy carboxylate oxime complexes | EASTMAN KODAK COMPANY (US) | 2021-06-15 | — | — | US | claimed |
| CN-111205397-A | Ionic liquid grafted cellulose nanocrystal and preparation method thereof | 青岛科技大学 | 2020-05-29 | — | — | CN | claimed |
| WO-2004031153-A2 | ENANTIOSELECTIVE ALKYLATION OF TRICYCLIC COMPOUNDS | SCHERING CORPORATION (US) | 2004-04-15 | — | — | WO | claimed |
| CN-1483715-A | Process for preparation of 3, 3-dimethyl-2-oxo-butyric acid | — | 2004-03-24 | — | — | CN | claimed |
| US-20040030186-A1 | Process for preparing 3,3-dimethyl-2-oxobutyric acid | BAYER AKTIENGESELLSCHAFT (DE) | 2004-02-12 | — | — | US | claimed |
| US-5091568-A | Oxygen-ruthenium oxide oxidation of 2-hydroxy-3,3-dimethyl-butanoic acid | MOBAY CORPORATION (US) | 1992-02-25 | — | — | US | claimed |
| US-4898974-A | Production of 3,3-dimethyl-2-oxo-butyric acid salt | BAYER AKTIENGESELLSCHAFT (DE) | 1990-02-06 | — | — | US | claimed |
| US-4614822-A | Catalytic oxidation of 3,3-dimethyl-2-hydroxybutyric acid to 2-oxo acid and preparation of 4-amino-6-tert.-butyl-3-thio-1,2,4-triazine-5(4-H)-one | MOBAY CHEMICAL CORPORATION (US) | 1986-09-30 | — | — | US | claimed |
| US-4564704-A | Production of 3,3-dimethyl-2-oxo-butyric acid salt | BAYER AKTIENGESELLSCHAFT (DE) | 1986-01-14 | — | — | US | claimed |
| EP-0000560-B1 | PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE ALPHA-HYDROXYCARBOXYLIC ACIDS | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1982-02-03 | — | — | EP | claimed |
| EP-0011207-B1 | PROCESS FOR THE PREPARATION OF 3,3-DIMETHYL-2-OXO-BUTANOIC ACID | Mobay Chemical Corporation (US) | 1981-11-25 | — | — | EP | claimed |
| US-4204044-A | SELECTIVE ASYMMETRIC, ENZYMATIC DEHYDROGENATIKN USING STREPTOMYCES, PSEUDOMONAS, BACILLUS OR CORYNEFORM MICROORGANISMS | HOFFMANN-LA ROCHE INC. (US) | 1980-05-20 | — | — | US | claimed |